#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gkn s ALA 898 N 0.00 3.59 0.45 4.31 0.00 -1.26 -4.71 121.76 124.14 1gkn s ALA 898 Ca 0.00 1.28 0.00 0.00 0.00 0.00 0.00 51.96 53.24 1gkn s ALA 898 Cb 0.00 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.59 1gkn s ALA 898 CO 0.00 -0.69 0.00 -1.91 0.00 0.00 0.00 175.76 173.16 1gkn n GLU 899 N 2.20 -3.74 -3.61 0.00 2.13 -1.26 -5.07 120.64 111.29 1gkn n GLU 899 Ca 0.06 2.80 -0.03 0.00 0.66 0.00 0.00 57.16 60.65 1gkn n GLU 899 Cb 0.41 -3.20 -0.06 0.00 0.27 0.00 0.00 31.44 28.85 1gkn n GLU 899 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1gkn s ALA 900 N -3.50 -2.18 -0.16 4.31 0.00 -1.26 -5.15 121.76 113.82 1gkn s ALA 900 Ca 0.00 2.28 0.02 0.00 0.00 0.00 0.00 51.96 54.25 1gkn s ALA 900 Cb 0.00 -1.68 0.01 0.00 0.00 0.00 0.00 23.12 21.46 1gkn s ALA 900 CO 0.00 -0.52 -0.21 -1.01 0.00 0.00 0.00 175.76 174.02 1gkn s HIS 901 N 1.80 2.71 -0.08 0.00 3.76 -1.26 -4.28 115.29 117.94 1gkn s HIS 901 Ca -0.08 -1.45 -0.28 0.00 -0.15 0.00 0.00 55.06 53.10 1gkn s HIS 901 Cb -0.05 -1.86 -0.02 0.00 1.11 0.00 0.00 32.58 31.76 1gkn s HIS 901 CO -0.17 -0.68 0.91 0.00 -0.85 0.00 0.00 174.74 173.94 1gkn n GLN 903 N 4.51 -2.43 -1.53 0.00 1.13 -1.26 -1.69 117.38 116.10 1gkn n GLN 903 Ca 0.05 -0.68 -0.49 0.00 -1.94 0.00 0.00 57.00 53.93 1gkn n GLN 903 Cb 0.50 -2.06 -0.04 0.00 0.11 0.00 0.00 30.24 28.75 1gkn n GLN 903 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1gkn n ALA 904 N -4.93 -1.50 -1.04 -1.58 0.00 -0.67 -4.74 120.51 106.04 1gkn n ALA 904 Ca 0.02 0.47 -0.31 0.00 0.00 0.00 0.00 53.44 53.62 1gkn n ALA 904 Cb 0.56 -1.91 -0.02 0.00 0.00 0.00 0.00 19.45 18.07 1gkn n ALA 904 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1gkn n PRO 905 N 1.44 2.60 0.00 0.00 -0.02 -1.26 -4.93 135.00 132.83 1gkn n PRO 905 Ca 0.16 -1.82 0.00 0.00 -2.02 0.00 0.00 63.50 59.81 1gkn n PRO 905 Cb 0.23 -2.68 0.00 0.00 -0.02 0.00 0.00 33.50 31.04 1gkn n PRO 905 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1gkn n ASP 906 N 4.50 0.00 -3.46 2.55 2.03 -1.26 -4.70 116.55 116.21 1gkn n ASP 906 Ca 0.56 0.00 0.01 0.00 0.52 0.00 0.00 54.79 55.88 1gkn n ASP 906 Cb 0.21 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.58 1gkn n ASP 906 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 1gkn s HIS 907 N 0.00 -1.31 0.04 -0.67 5.65 -1.26 -5.14 115.29 112.61 1gkn s HIS 907 Ca 0.00 1.95 -0.24 0.00 0.25 0.00 0.00 55.06 57.02 1gkn s HIS 907 Cb 0.00 0.67 -0.06 0.00 -1.18 0.00 0.00 32.58 32.01 1gkn s HIS 907 CO 0.00 -0.67 0.71 -0.06 -0.65 0.00 0.00 174.74 174.07 1gkn s PHE 908 N 2.84 3.74 -0.05 3.88 0.40 -1.26 -4.99 117.98 122.54 1gkn s PHE 908 Ca 0.02 1.41 -0.25 0.00 -0.60 0.00 0.00 56.93 57.51 1gkn s PHE 908 Cb -0.12 -2.75 -0.23 0.00 0.51 0.00 0.00 43.02 40.43 1gkn s PHE 908 CO -0.19 0.32 1.05 -0.07 0.70 0.00 0.00 175.22 177.03 1gkn h LEU 909 N 5.52 0.16 -1.50 -0.37 4.07 -2.02 -3.23 115.31 117.94 1gkn h LEU 909 Ca -0.45 -0.74 0.00 0.00 0.08 0.00 0.00 57.88 56.77 1gkn h LEU 909 Cb 1.20 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.90 1gkn h LEU 909 CO 0.70 0.87 0.00 2.22 -1.08 0.00 0.00 178.44 181.15 1gkn n PHE 910 N -4.59 0.52 -3.65 1.13 1.16 -1.26 -4.73 117.46 106.03 1gkn n PHE 910 Ca -0.09 -0.19 -0.04 0.00 -1.87 0.00 0.00 57.45 55.26 1gkn n PHE 910 Cb 0.44 -0.17 -0.06 0.00 -1.61 0.00 0.00 39.48 38.09 1gkn n PHE 910 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1gkn s ALA 911 N -1.55 -1.74 -0.20 1.98 0.00 -1.22 -1.90 121.76 117.14 1gkn s ALA 911 Ca 0.15 2.10 -0.08 0.00 0.00 0.00 0.00 51.96 54.12 1gkn s ALA 911 Cb 0.11 -1.57 -0.04 0.00 0.00 0.00 0.00 23.12 21.61 1gkn s ALA 911 CO 0.06 -0.78 0.09 -1.59 0.00 0.00 0.00 175.76 173.54 1gkn s LYS 912 N 2.58 4.01 -0.08 0.00 -2.85 0.49 -4.01 119.74 119.88 1gkn s LYS 912 Ca -0.06 -0.32 -0.38 0.00 -1.00 0.00 0.00 55.97 54.22 1gkn s LYS 912 Cb -0.11 -3.30 -0.16 0.00 -2.06 0.00 0.00 37.83 32.21 1gkn s LYS 912 CO -0.17 0.23 1.54 -0.11 0.10 0.00 0.00 175.35 176.94 1gkn n LEU 913 N 3.69 2.08 -0.06 2.77 0.00 -1.26 -1.26 117.00 122.96 1gkn n LEU 913 Ca -0.16 1.09 -0.11 0.00 0.00 0.00 0.00 56.01 56.83 1gkn n LEU 913 Cb 0.52 -1.18 -0.15 0.00 0.00 0.00 0.00 43.42 42.61 1gkn n LEU 913 CO 0.35 -0.72 -0.84 1.17 0.00 0.00 0.00 177.39 177.36 1gkn n LYS 914 N 3.95 0.67 -1.86 1.96 4.81 -0.95 -4.78 118.16 121.96 1gkn n LYS 914 Ca 0.22 0.17 -0.41 0.00 -0.87 0.00 0.00 58.31 57.42 1gkn n LYS 914 Cb 0.17 -1.67 -0.02 0.00 0.02 0.00 0.00 35.03 33.54 1gkn n LYS 914 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1gkn s THR 915 N -2.55 2.26 -1.48 3.15 2.01 -1.18 -4.88 115.64 112.98 1gkn s THR 915 Ca -0.10 0.23 -0.10 0.00 0.31 0.00 0.00 61.69 62.03 1gkn s THR 915 Cb 0.07 -3.15 -0.07 0.00 0.01 0.00 0.00 72.50 69.36 1gkn s THR 915 CO 0.81 0.04 2.73 0.00 -0.69 0.00 0.00 174.62 177.51 1gkn n GLN 916 N 1.95 3.30 -0.07 4.92 0.00 -1.26 -4.57 117.38 121.66 1gkn n GLN 916 Ca 0.06 -2.11 -0.10 0.00 0.00 0.00 0.00 57.00 54.85 1gkn n GLN 916 Cb 0.39 -2.80 -0.09 0.00 0.00 0.00 0.00 30.24 27.74 1gkn n GLN 916 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1gkn h THR 917 N 3.21 1.22 -6.16 -0.39 1.03 -1.97 -3.48 112.91 106.36 1gkn h THR 917 Ca 0.77 -1.94 -0.42 0.00 -0.01 0.00 0.00 66.41 64.82 1gkn h THR 917 Cb 0.31 2.32 0.06 0.00 -1.07 0.00 0.00 68.15 69.77 1gkn h THR 917 CO 1.75 0.41 -0.89 0.41 -0.01 0.00 0.00 175.52 177.19 1gkn n THR 918 N -4.65 -5.26 -3.53 0.00 -1.04 -1.26 -4.98 114.28 93.55 1gkn n THR 918 Ca -0.08 -0.78 -0.10 0.00 -2.04 0.00 0.00 64.05 61.05 1gkn n THR 918 Cb 0.35 -4.08 -0.04 0.00 -1.82 0.00 0.00 70.33 64.74 1gkn n THR 918 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1gkn s ALA 919 N -3.61 -1.86 -0.12 2.41 0.00 -1.26 -5.07 121.76 112.24 1gkn s ALA 919 Ca 0.24 1.26 -0.17 0.00 0.00 0.00 0.00 51.96 53.30 1gkn s ALA 919 Cb -0.08 -0.06 -0.26 0.00 0.00 0.00 0.00 23.12 22.73 1gkn s ALA 919 CO 0.84 -0.52 0.50 1.03 0.00 0.00 0.00 175.76 177.61 1gkn h SER 920 N 2.29 0.30 -3.50 0.00 0.87 -1.96 -3.46 113.55 108.09 1gkn h SER 920 Ca -0.21 -0.81 -0.53 0.00 -1.23 0.00 0.00 61.79 59.01 1gkn h SER 920 Cb 1.20 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 63.03 1gkn h SER 920 CO 0.31 1.58 0.18 1.51 -0.53 0.00 0.00 176.83 179.88 1gkn s ASP 921 N -6.95 7.36 -0.02 6.23 1.47 -1.26 -1.67 116.67 121.81 1gkn s ASP 921 Ca -0.21 1.61 0.04 0.00 1.18 0.00 0.00 52.55 55.17 1gkn s ASP 921 Cb 0.04 -2.49 -0.01 0.00 -0.34 0.00 0.00 42.92 40.12 1gkn s ASP 921 CO 0.73 0.17 -0.16 -0.36 0.68 0.00 0.00 175.17 176.24 1gkn s PHE 922 N -0.94 1.47 0.12 2.11 0.40 -0.68 -4.96 117.98 115.50 1gkn s PHE 922 Ca 0.36 -0.34 -0.30 0.00 -0.60 0.00 0.00 56.93 56.05 1gkn s PHE 922 Cb -0.23 -0.97 -0.07 0.00 0.51 0.00 0.00 43.02 42.26 1gkn s PHE 922 CO 0.26 -0.08 1.25 -1.25 0.70 0.00 0.00 175.22 176.10 1gkn s PRO 923 N -0.16 4.42 0.60 0.24 0.04 -1.26 -2.03 135.00 136.85 1gkn s PRO 923 Ca 0.02 1.90 -0.19 0.00 0.04 0.00 0.00 61.00 62.77 1gkn s PRO 923 Cb -0.08 -3.28 -0.04 0.00 0.04 0.00 0.00 34.50 31.14 1gkn s PRO 923 CO 0.00 -0.25 1.12 -0.89 0.04 0.00 0.00 177.00 177.03 1gkn n ILE 924 N 3.37 4.05 0.00 0.56 5.41 -1.26 -2.33 119.36 129.17 1gkn n ILE 924 Ca 0.08 -0.50 0.00 0.00 1.00 0.00 0.00 62.75 63.33 1gkn n ILE 924 Cb 0.45 -1.32 0.00 0.00 -0.71 0.00 0.00 39.64 38.05 1gkn n ILE 924 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1gkn n GLY 925 N 1.10 2.55 3.69 7.39 0.00 0.71 -4.99 105.19 115.63 1gkn n GLY 925 Ca 0.14 -0.22 -0.44 0.00 0.00 0.00 0.00 46.02 45.49 1gkn n GLY 925 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1gkn n THR 926 N 0.00 0.01 -3.16 2.61 -1.04 -0.98 -4.67 114.28 107.05 1gkn n THR 926 Ca 0.00 -0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.70 1gkn n THR 926 Cb 0.00 -1.72 -0.05 0.00 -1.82 0.00 0.00 70.33 66.74 1gkn n THR 926 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1gkn s SER 927 N 1.05 6.63 -0.27 8.00 0.15 -1.26 -2.32 113.70 125.68 1gkn s SER 927 Ca 0.77 1.09 -0.04 0.00 0.70 0.00 0.00 55.95 58.47 1gkn s SER 927 Cb -0.61 -2.30 0.10 0.00 -1.71 0.00 0.00 66.02 61.50 1gkn s SER 927 CO 0.36 -0.22 0.14 -0.22 1.20 0.00 0.00 173.24 174.50 1gkn s LEU 928 N -3.23 0.41 0.00 3.45 2.96 -1.02 -4.89 118.68 116.36 1gkn s LEU 928 Ca 0.51 -1.08 -0.24 0.00 -0.22 0.00 0.00 54.13 53.09 1gkn s LEU 928 Cb -0.11 -0.22 -0.05 0.00 0.50 0.00 0.00 46.19 46.31 1gkn s LEU 928 CO 0.23 -0.41 0.74 -1.59 -1.32 0.00 0.00 176.35 174.00 1gkn s LYS 929 N 2.14 4.47 -0.11 1.98 -2.85 -1.26 -0.06 119.74 124.04 1gkn s LYS 929 Ca 0.08 1.00 -0.01 0.00 -1.00 0.00 0.00 55.97 56.04 1gkn s LYS 929 Cb -0.16 -3.40 -0.02 0.00 -2.06 0.00 0.00 37.83 32.19 1gkn s LYS 929 CO -0.31 0.19 -0.09 0.71 0.10 0.00 0.00 175.35 175.96 1gkn s TYR 930 N 0.29 2.90 -0.20 1.78 1.51 -1.00 -2.23 117.35 120.41 1gkn s TYR 930 Ca 0.38 -0.29 -0.15 0.00 -1.01 0.00 0.00 57.07 56.01 1gkn s TYR 930 Cb -0.19 -1.82 -0.04 0.00 -0.11 0.00 0.00 41.96 39.80 1gkn s TYR 930 CO 0.21 0.04 0.34 -1.83 -1.11 0.00 0.00 175.55 173.20 1gkn s GLU 931 N -0.10 4.18 0.60 -0.62 -1.05 -0.39 -2.47 118.70 118.85 1gkn s GLU 931 Ca 0.00 0.11 -0.19 0.00 -0.15 0.00 0.00 54.97 54.74 1gkn s GLU 931 Cb -0.13 -3.51 -0.04 0.00 -0.44 0.00 0.00 34.13 30.01 1gkn s GLU 931 CO 0.03 0.05 1.18 0.00 0.95 0.00 0.00 175.26 177.47 1gkn s ARG 933 N -2.97 3.29 0.25 0.00 0.52 -0.80 -4.74 118.95 114.50 1gkn s ARG 933 Ca 0.77 0.24 -0.28 0.00 -0.52 0.00 0.00 55.73 55.94 1gkn s ARG 933 Cb -0.41 -2.26 -0.15 0.00 0.52 0.00 0.00 34.95 32.64 1gkn s ARG 933 CO 0.46 -0.50 0.80 -2.30 0.02 0.00 0.00 175.30 173.78 1gkn n PRO 934 N -2.51 0.76 -1.18 3.54 -0.02 -1.26 -2.25 135.00 132.09 1gkn n PRO 934 Ca 0.03 0.27 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 1gkn n PRO 934 Cb 0.56 -1.48 0.00 0.00 -0.02 0.00 0.00 33.50 32.56 1gkn n PRO 934 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1gkn n GLU 935 N 0.84 0.00 -3.81 -0.52 1.02 -1.26 -5.02 120.64 111.89 1gkn n GLU 935 Ca 0.13 0.29 -0.12 0.00 -0.02 0.00 0.00 57.16 57.44 1gkn n GLU 935 Cb 0.29 -3.35 -0.10 0.00 -0.02 0.00 0.00 31.44 28.25 1gkn n GLU 935 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1gkn s TYR 936 N -2.00 -0.15 -0.05 -0.32 1.51 -0.95 -0.81 117.35 114.57 1gkn s TYR 936 Ca 0.00 0.32 -0.05 0.00 -1.01 0.00 0.00 57.07 56.33 1gkn s TYR 936 Cb 0.00 0.05 0.01 0.00 -0.11 0.00 0.00 41.96 41.91 1gkn s TYR 936 CO 0.00 -0.24 0.14 1.52 -1.11 0.00 0.00 175.55 175.86 1gkn s TYR 937 N -0.68 -0.14 0.00 2.71 -0.85 -0.35 -4.75 117.35 113.29 1gkn s TYR 937 Ca -0.08 0.34 0.00 0.00 -0.52 0.00 0.00 57.07 56.82 1gkn s TYR 937 Cb -0.04 0.04 0.00 0.00 0.38 0.00 0.00 41.96 42.34 1gkn s TYR 937 CO 0.02 -0.09 0.00 0.41 -1.52 0.00 0.00 175.55 174.36 1gkn n GLY 938 N 2.87 0.00 1.28 5.49 0.00 -1.26 -2.23 105.19 111.34 1gkn n GLY 938 Ca -0.13 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.05 1gkn n GLY 938 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gkn n ARG 939 N 0.00 -2.87 -2.52 1.61 1.74 -1.26 -4.49 116.66 108.87 1gkn n ARG 939 Ca 0.00 2.27 -0.43 0.00 -0.77 0.00 0.00 57.85 58.92 1gkn n ARG 939 Cb 0.00 -3.39 -0.02 0.00 -1.02 0.00 0.00 32.46 28.03 1gkn n ARG 939 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1gkn s PRO 940 N -3.69 3.97 -0.48 5.56 0.04 -1.26 -4.66 135.00 134.48 1gkn s PRO 940 Ca 0.00 1.15 -0.22 0.00 0.04 0.00 0.00 61.00 61.97 1gkn s PRO 940 Cb 0.00 -3.82 0.04 0.00 0.04 0.00 0.00 34.50 30.75 1gkn s PRO 940 CO 0.00 -1.04 0.77 -0.59 0.04 0.00 0.00 177.00 176.18 1gkn s PHE 941 N 4.07 2.97 -0.07 0.56 -0.71 -1.03 -4.71 117.98 119.06 1gkn s PHE 941 Ca 0.52 -0.06 -0.30 0.00 -1.04 0.00 0.00 56.93 56.05 1gkn s PHE 941 Cb -0.15 -3.68 -0.03 0.00 -1.21 0.00 0.00 43.02 37.96 1gkn s PHE 941 CO 0.20 -1.06 1.12 -1.54 -1.34 0.00 0.00 175.22 172.60 1gkn s SER 942 N 2.39 7.13 0.04 1.98 1.04 -1.26 -2.36 113.70 122.66 1gkn s SER 942 Ca 0.26 1.71 0.00 0.00 0.48 0.00 0.00 55.95 58.40 1gkn s SER 942 Cb -0.14 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.42 1gkn s SER 942 CO 0.19 -0.52 0.00 2.30 0.98 0.00 0.00 173.24 176.19 1gkn n ILE 943 N 4.54 0.00 -3.62 -1.02 -5.35 0.91 -4.77 119.36 110.05 1gkn n ILE 943 Ca 0.10 0.00 -0.02 0.00 -0.27 0.00 0.00 62.75 62.56 1gkn n ILE 943 Cb 0.47 -1.25 -0.04 0.00 -1.74 0.00 0.00 39.64 37.07 1gkn n ILE 943 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 1gkn s THR 944 N 1.34 -0.81 -0.58 7.28 2.01 -1.26 -2.44 115.64 121.18 1gkn s THR 944 Ca 0.00 0.00 -0.27 0.00 0.31 0.00 0.00 61.69 61.73 1gkn s THR 944 Cb 0.00 -1.00 -0.01 0.00 0.01 0.00 0.00 72.50 71.50 1gkn s THR 944 CO 0.00 0.00 1.70 0.00 -0.69 0.00 0.00 174.62 175.63 1gkn s LEU 946 N 7.84 3.18 0.39 0.00 1.43 -0.82 -0.21 118.68 130.48 1gkn s LEU 946 Ca 0.62 1.27 0.22 0.00 -1.03 0.00 0.00 54.13 55.21 1gkn s LEU 946 Cb -0.13 -4.24 1.29 0.00 0.03 0.00 0.00 46.19 43.14 1gkn s LEU 946 CO 0.22 -0.97 1.63 -0.78 0.23 0.00 0.00 176.35 176.68 1gkn h ASP 947 N -0.35 0.36 -0.15 2.29 1.82 -1.93 0.67 116.42 119.12 1gkn h ASP 947 Ca -0.45 0.19 -0.10 0.00 -0.39 0.00 0.00 57.03 56.29 1gkn h ASP 947 Cb 1.21 0.17 -0.05 0.00 0.68 0.00 0.00 39.33 41.34 1gkn h ASP 947 CO 0.62 -0.23 0.12 0.59 -1.61 0.00 0.00 179.24 178.74 1gkn n ASN 948 N -4.96 4.84 -4.18 2.28 3.02 -1.26 -4.79 115.26 110.20 1gkn n ASN 948 Ca 0.35 -2.50 -0.32 0.00 -0.03 0.00 0.00 54.58 52.09 1gkn n ASN 948 Cb 1.23 -0.92 -0.05 0.00 -0.61 0.00 0.00 39.78 39.43 1gkn n ASN 948 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1gkn n LEU 949 N 0.83 -1.61 0.00 3.41 4.32 0.22 -4.92 117.00 119.24 1gkn n LEU 949 Ca 0.10 -1.11 0.00 0.00 -0.02 0.00 0.00 56.01 54.98 1gkn n LEU 949 Cb 0.58 -1.96 0.00 0.00 -1.62 0.00 0.00 43.42 40.42 1gkn n LEU 949 CO 0.11 0.37 0.00 1.33 -1.22 0.00 0.00 177.39 177.98 1gkn n VAL 950 N -4.41 0.00 -3.67 4.08 0.24 -1.14 -4.42 118.33 109.01 1gkn n VAL 950 Ca -0.17 0.00 -0.08 0.00 -2.04 0.00 0.00 64.34 62.05 1gkn n VAL 950 Cb 0.61 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.89 1gkn n VAL 950 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 1gkn s TRP 951 N 0.24 -0.79 0.43 6.34 0.52 -1.25 -1.94 118.94 122.48 1gkn s TRP 951 Ca 0.00 1.53 -0.21 0.00 0.02 0.00 0.00 56.10 57.44 1gkn s TRP 951 Cb 0.00 0.33 -0.14 0.00 -1.15 0.00 0.00 33.47 32.52 1gkn s TRP 951 CO 0.00 -0.46 0.32 0.45 0.02 0.00 0.00 176.95 177.28 1gkn n SER 952 N 5.08 -1.88 -4.65 2.95 2.88 -0.79 -4.84 113.62 112.37 1gkn n SER 952 Ca -0.13 0.85 -0.43 0.00 -1.33 0.00 0.00 58.87 57.83 1gkn n SER 952 Cb 0.51 -1.00 -0.02 0.00 -0.75 0.00 0.00 64.21 62.95 1gkn n SER 952 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1gkn s SER 953 N -0.99 6.96 -1.36 -3.46 0.15 -1.26 -4.65 113.70 109.09 1gkn s SER 953 Ca 0.62 1.20 -0.09 0.00 0.70 0.00 0.00 55.95 58.37 1gkn s SER 953 Cb -0.61 -2.54 -0.07 0.00 -1.71 0.00 0.00 66.02 61.09 1gkn s SER 953 CO 0.60 -0.83 2.61 -2.65 1.20 0.00 0.00 173.24 174.17 1gkn n PRO 954 N 6.73 3.05 -2.57 5.44 -0.02 -1.26 -4.93 135.00 141.43 1gkn n PRO 954 Ca 0.12 -1.97 -0.42 0.00 -2.02 0.00 0.00 63.50 59.22 1gkn n PRO 954 Cb 0.47 -2.72 -0.03 0.00 -0.02 0.00 0.00 33.50 31.19 1gkn n PRO 954 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1gkn s LYS 955 N 2.73 4.54 -0.40 -0.52 2.20 -1.26 -4.27 119.74 122.77 1gkn s LYS 955 Ca 0.58 1.60 -0.19 0.00 -0.36 0.00 0.00 55.97 57.61 1gkn s LYS 955 Cb 0.15 -3.37 0.03 0.00 -1.51 0.00 0.00 37.83 33.12 1gkn s LYS 955 CO -0.05 -0.06 0.52 -0.25 -0.36 0.00 0.00 175.35 175.15 1gkn n ASP 956 N 3.46 -7.40 0.00 1.43 8.00 -1.26 -4.97 116.55 115.81 1gkn n ASP 956 Ca 0.06 0.49 0.00 0.00 0.71 0.00 0.00 54.79 56.05 1gkn n ASP 956 Cb 0.48 -4.45 0.00 0.00 -0.02 0.00 0.00 41.12 37.13 1gkn n ASP 956 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1gkn n VAL 957 N -0.09 0.00 -3.71 2.53 0.24 -1.26 -5.11 118.33 110.93 1gkn n VAL 957 Ca 0.06 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.24 1gkn n VAL 957 Cb 0.46 0.00 -0.11 0.00 -1.47 0.00 0.00 33.84 32.72 1gkn n VAL 957 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1gkn s LYS 959 N 1.00 0.34 0.42 0.00 -0.14 -0.95 -4.98 119.74 115.44 1gkn s LYS 959 Ca -0.06 -0.27 -0.24 0.00 -1.36 0.00 0.00 55.97 54.03 1gkn s LYS 959 Cb -0.07 0.14 -0.10 0.00 -1.68 0.00 0.00 37.83 36.12 1gkn s LYS 959 CO -0.08 -0.07 1.04 -2.13 -0.76 0.00 0.00 175.35 173.35 1gkn n ARG 960 N 1.97 1.42 -1.43 1.68 0.63 -1.26 -1.21 116.66 118.45 1gkn n ARG 960 Ca -0.20 0.51 -0.36 0.00 -0.92 0.00 0.00 57.85 56.88 1gkn n ARG 960 Cb 0.57 -2.08 0.08 0.00 0.45 0.00 0.00 32.46 31.47 1gkn n ARG 960 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1gkn n LYS 961 N 0.14 0.61 -3.68 -0.14 5.02 0.01 -4.72 118.16 115.39 1gkn n LYS 961 Ca 0.09 0.26 -0.18 0.00 -2.02 0.00 0.00 58.31 56.46 1gkn n LYS 961 Cb 0.39 -2.22 -0.17 0.00 -0.02 0.00 0.00 35.03 33.01 1gkn n LYS 961 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1gkn s SER 962 N -1.55 0.85 0.47 4.39 1.04 -1.26 -2.27 113.70 115.37 1gkn s SER 962 Ca 0.74 0.20 -0.16 0.00 0.48 0.00 0.00 55.95 57.21 1gkn s SER 962 Cb -0.36 0.06 -0.08 0.00 0.10 0.00 0.00 66.02 65.74 1gkn s SER 962 CO 0.49 -0.24 0.92 0.00 0.98 0.00 0.00 173.24 175.39 1gkn s LYS 964 N -3.84 4.25 0.25 0.00 2.20 -1.26 -4.92 119.74 116.41 1gkn s LYS 964 Ca 0.57 2.30 -0.31 0.00 -0.36 0.00 0.00 55.97 58.17 1gkn s LYS 964 Cb -0.10 -3.14 -0.13 0.00 -1.51 0.00 0.00 37.83 32.95 1gkn s LYS 964 CO 0.28 -0.50 1.49 2.41 -0.36 0.00 0.00 175.35 178.67 1gkn n THR 965 N 3.20 0.86 -1.48 3.43 -1.04 -1.26 -4.92 114.28 113.07 1gkn n THR 965 Ca 0.10 -0.21 -0.37 0.00 -2.04 0.00 0.00 64.05 61.53 1gkn n THR 965 Cb 0.40 -1.66 0.06 0.00 -1.82 0.00 0.00 70.33 67.31 1gkn n THR 965 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1gkn n PRO 966 N 2.26 0.61 -0.51 -2.82 -0.04 -1.26 -4.79 135.00 128.45 1gkn n PRO 966 Ca 0.11 0.25 -0.04 0.00 -0.04 0.00 0.00 63.50 63.78 1gkn n PRO 966 Cb 0.33 -1.96 -0.06 0.00 -0.04 0.00 0.00 33.50 31.76 1gkn n PRO 966 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1gkn n PRO 967 N -0.77 1.02 0.00 0.54 -0.04 -1.26 -4.88 135.00 129.60 1gkn n PRO 967 Ca 0.12 -0.36 0.00 0.00 -0.04 0.00 0.00 63.50 63.22 1gkn n PRO 967 Cb 0.48 -1.53 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 1gkn n PRO 967 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1gkn n ASP 968 N 2.22 0.00 -4.49 3.54 9.92 -1.26 -4.69 116.55 121.79 1gkn n ASP 968 Ca 0.16 0.00 -0.44 0.00 -0.53 0.00 0.00 54.79 53.98 1gkn n ASP 968 Cb 0.48 0.00 -0.01 0.00 -0.64 0.00 0.00 41.12 40.95 1gkn n ASP 968 CO 0.00 0.00 0.00 -2.65 0.13 0.00 0.00 177.20 174.68 1gkn n PRO 969 N 1.34 0.75 -1.59 -0.24 -0.02 -1.26 -4.79 135.00 129.19 1gkn n PRO 969 Ca 0.00 0.26 -0.51 0.00 -2.02 0.00 0.00 63.50 61.24 1gkn n PRO 969 Cb 0.00 -1.53 -0.05 0.00 -0.02 0.00 0.00 33.50 31.90 1gkn n PRO 969 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 1gkn n VAL 970 N -0.30 0.33 0.00 -1.45 3.14 -1.26 -1.87 118.33 116.92 1gkn n VAL 970 Ca 0.12 -0.08 0.00 0.00 -2.96 0.00 0.00 64.34 61.42 1gkn n VAL 970 Cb 0.34 -0.86 0.00 0.00 -1.06 0.00 0.00 33.84 32.26 1gkn n VAL 970 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 1gkn n ASN 971 N 2.36 0.00 -3.23 6.55 3.02 -1.26 -4.24 115.26 118.46 1gkn n ASN 971 Ca 0.17 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.72 1gkn n ASN 971 Cb 0.22 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.39 1gkn n ASN 971 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gkn n GLY 972 N 0.00 -0.36 0.00 7.41 0.00 -0.78 -4.76 105.19 106.70 1gkn n GLY 972 Ca 0.00 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.60 1gkn n GLY 972 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1gkn n MET 973 N 0.00 0.00 -3.39 1.61 0.00 -0.94 -4.67 117.12 109.73 1gkn n MET 973 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 57.70 57.33 1gkn n MET 973 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 33.22 33.15 1gkn n MET 973 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 1gkn s VAL 974 N -1.35 5.22 -0.28 3.17 0.11 -1.26 -2.29 120.40 123.73 1gkn s VAL 974 Ca 0.00 0.78 -0.09 0.00 -2.93 0.00 0.00 61.98 59.75 1gkn s VAL 974 Cb 0.00 -3.75 -0.02 0.00 -1.53 0.00 0.00 36.38 31.08 1gkn s VAL 974 CO 0.00 0.33 0.12 -1.38 -3.33 0.00 0.00 175.10 170.84 1gkn s HIS 975 N 0.74 3.15 0.35 1.54 -3.43 0.46 -4.97 115.29 113.13 1gkn s HIS 975 Ca 0.22 -0.41 -0.27 0.00 -0.80 0.00 0.00 55.06 53.80 1gkn s HIS 975 Cb -0.14 -2.31 -0.09 0.00 -1.43 0.00 0.00 32.58 28.61 1gkn s HIS 975 CO 0.08 -0.37 1.18 0.14 -2.00 0.00 0.00 174.74 173.76 1gkn s VAL 976 N 1.64 3.17 0.13 -5.38 -7.23 -1.26 -2.29 120.40 109.17 1gkn s VAL 976 Ca 0.06 1.08 -0.06 0.00 -1.81 0.00 0.00 61.98 61.25 1gkn s VAL 976 Cb -0.16 -3.65 -0.16 0.00 0.56 0.00 0.00 36.38 32.97 1gkn s VAL 976 CO 0.06 0.18 1.32 0.40 -0.31 0.00 0.00 175.10 176.76 1gkn h ILE 977 N 2.72 1.36 0.00 -0.62 1.08 -1.91 -3.44 117.51 116.70 1gkn h ILE 977 Ca -0.48 -2.27 0.00 0.00 -0.39 0.00 0.00 64.86 61.71 1gkn h ILE 977 Cb 1.22 2.27 0.00 0.00 -3.07 0.00 0.00 36.82 37.25 1gkn h ILE 977 CO 0.64 0.69 0.00 0.35 -0.69 0.00 0.00 178.15 179.14 1gkn n THR 978 N -3.81 0.00 0.00 -0.27 -2.24 -1.26 -5.09 114.28 101.61 1gkn n THR 978 Ca -0.07 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 1gkn n THR 978 Cb 0.80 -0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 1gkn n THR 978 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1gkn n ASP 979 N -2.27 3.87 -2.17 3.42 2.03 -1.26 -5.08 116.55 115.09 1gkn n ASP 979 Ca 0.00 0.00 -0.01 0.00 0.52 0.00 0.00 54.79 55.30 1gkn n ASP 979 Cb 0.00 0.00 0.05 0.00 -0.72 0.00 0.00 41.12 40.45 1gkn n ASP 979 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 1gkn n ILE 980 N 0.00 0.35 -1.65 5.18 -5.35 -1.26 -4.76 119.36 111.87 1gkn n ILE 980 Ca 0.00 -1.33 -0.30 0.00 -0.27 0.00 0.00 62.75 60.86 1gkn n ILE 980 Cb 0.00 0.98 0.09 0.00 -1.74 0.00 0.00 39.64 38.98 1gkn n ILE 980 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1gkn s GLN 981 N -1.02 1.97 0.00 6.28 -1.52 -1.26 -3.00 119.66 121.11 1gkn s GLN 981 Ca 0.16 0.45 0.00 0.00 -1.95 0.00 0.00 55.36 54.03 1gkn s GLN 981 Cb 0.31 -1.92 0.00 0.00 -0.22 0.00 0.00 33.01 31.18 1gkn s GLN 981 CO -0.08 -1.66 0.21 1.33 -0.25 0.00 0.00 175.29 174.84 1gkn n VAL 982 N -3.43 0.21 0.00 1.09 0.24 -0.96 -1.60 118.33 113.88 1gkn n VAL 982 Ca 0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.37 1gkn n VAL 982 Cb 0.58 -0.59 0.00 0.00 -1.47 0.00 0.00 33.84 32.36 1gkn n VAL 982 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1gkn n GLY 983 N 0.87 0.00 3.74 7.63 0.00 -0.73 -4.15 105.19 112.55 1gkn n GLY 983 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1gkn n GLY 983 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1gkn s SER 984 N -0.54 7.32 0.41 1.61 0.15 -0.63 -4.70 113.70 117.32 1gkn s SER 984 Ca 0.00 2.08 -0.04 0.00 0.70 0.00 0.00 55.95 58.69 1gkn s SER 984 Cb 0.00 -2.61 -0.04 0.00 -1.71 0.00 0.00 66.02 61.66 1gkn s SER 984 CO 0.00 -0.16 0.69 -0.60 1.20 0.00 0.00 173.24 174.37 1gkn s ARG 985 N -0.57 3.56 -0.03 5.44 3.52 -1.26 -2.30 118.95 127.30 1gkn s ARG 985 Ca 0.48 0.07 0.00 0.00 -0.13 0.00 0.00 55.73 56.15 1gkn s ARG 985 Cb -0.29 -2.49 0.03 0.00 -1.56 0.00 0.00 34.95 30.64 1gkn s ARG 985 CO 0.35 -0.04 -0.00 0.96 -0.81 0.00 0.00 175.30 175.76 1gkn s ILE 986 N -2.51 0.19 -0.10 4.11 -4.36 -0.75 -2.82 121.20 114.97 1gkn s ILE 986 Ca 0.45 0.09 -0.03 0.00 -0.26 0.00 0.00 60.65 60.90 1gkn s ILE 986 Cb -0.10 -0.29 -0.03 0.00 1.25 0.00 0.00 42.46 43.28 1gkn s ILE 986 CO 0.39 0.15 0.04 0.42 0.24 0.00 0.00 174.94 176.18 1gkn s THR 987 N 1.09 4.60 0.02 8.37 -4.23 -0.97 -2.05 115.64 122.47 1gkn s THR 987 Ca -0.09 -0.13 0.00 0.00 -1.18 0.00 0.00 61.69 60.29 1gkn s THR 987 Cb -0.13 -2.96 -0.04 0.00 1.34 0.00 0.00 72.50 70.71 1gkn s THR 987 CO -0.02 0.60 0.10 -0.31 -0.54 0.00 0.00 174.62 174.46 1gkn s TYR 988 N -0.87 3.30 -0.21 3.99 1.51 -0.58 -0.40 117.35 124.10 1gkn s TYR 988 Ca 0.13 0.19 -0.09 0.00 -1.01 0.00 0.00 57.07 56.29 1gkn s TYR 988 Cb -0.12 -1.72 0.08 0.00 -0.11 0.00 0.00 41.96 40.10 1gkn s TYR 988 CO 0.03 0.55 0.46 0.45 -1.11 0.00 0.00 175.55 175.94 1gkn s SER 989 N -1.98 -0.49 0.00 2.29 0.15 -0.97 -4.92 113.70 107.78 1gkn s SER 989 Ca 0.26 1.07 0.00 0.00 0.70 0.00 0.00 55.95 57.98 1gkn s SER 989 Cb -0.12 1.26 0.00 0.00 -1.71 0.00 0.00 66.02 65.45 1gkn s SER 989 CO 0.17 -0.22 0.00 0.00 1.20 0.00 0.00 173.24 174.40 1gkn s THR 991 N 0.00 0.00 -0.78 0.00 -1.32 -1.26 -4.53 115.64 107.75 1gkn s THR 991 Ca 0.00 0.00 -0.19 0.00 -1.21 0.00 0.00 61.69 60.29 1gkn s THR 991 Cb 0.00 -1.00 -0.18 0.00 -1.51 0.00 0.00 72.50 69.81 1gkn s THR 991 CO 0.00 0.00 2.01 0.41 -2.21 0.00 0.00 174.62 174.83 1gkn n THR 992 N -0.10 0.00 0.00 5.08 -1.04 -1.26 -1.99 114.28 114.97 1gkn n THR 992 Ca -0.06 -0.34 0.00 0.00 -2.04 0.00 0.00 64.05 61.61 1gkn n THR 992 Cb 0.60 -1.28 0.00 0.00 -1.82 0.00 0.00 70.33 67.83 1gkn n THR 992 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1gkn n GLY 993 N 5.94 1.02 3.20 3.41 0.00 -1.26 -5.14 105.19 112.35 1gkn n GLY 993 Ca 0.40 -0.07 -0.25 0.00 0.00 0.00 0.00 46.02 46.10 1gkn n GLY 993 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1gkn s HIS 994 N 0.00 1.63 0.12 1.61 4.02 -0.84 -2.85 115.29 118.99 1gkn s HIS 994 Ca 0.00 -0.33 -0.12 0.00 1.02 0.00 0.00 55.06 55.63 1gkn s HIS 994 Cb 0.00 -1.01 -0.06 0.00 -1.02 0.00 0.00 32.58 30.48 1gkn s HIS 994 CO 0.00 0.02 0.49 -0.98 1.02 0.00 0.00 174.74 175.29 1gkn s ARG 995 N -0.75 3.88 0.19 1.40 1.70 0.13 -4.12 118.95 121.38 1gkn s ARG 995 Ca 0.06 0.35 -0.30 0.00 -0.47 0.00 0.00 55.73 55.37 1gkn s ARG 995 Cb -0.08 -2.94 -0.08 0.00 -0.57 0.00 0.00 34.95 31.28 1gkn s ARG 995 CO 0.00 0.50 1.19 -1.17 -1.08 0.00 0.00 175.30 174.75 1gkn s LEU 996 N -1.98 4.45 -0.02 -1.89 0.20 -1.26 -1.68 118.68 116.50 1gkn s LEU 996 Ca 0.36 2.24 0.05 0.00 0.69 0.00 0.00 54.13 57.48 1gkn s LEU 996 Cb -0.14 -3.61 -0.01 0.00 -0.43 0.00 0.00 46.19 42.00 1gkn s LEU 996 CO 0.19 -0.36 -0.17 -0.63 -0.29 0.00 0.00 176.35 175.08 1gkn s ILE 997 N -0.14 1.38 0.00 6.68 1.09 0.13 -4.94 121.20 125.41 1gkn s ILE 997 Ca 0.52 -0.74 0.00 0.00 -1.10 0.00 0.00 60.65 59.33 1gkn s ILE 997 Cb -0.33 -1.16 0.00 0.00 -1.06 0.00 0.00 42.46 39.92 1gkn s ILE 997 CO 0.37 0.39 0.00 0.61 -0.10 0.00 0.00 174.94 176.21 1gkn n GLY 998 N 2.71 0.78 0.00 6.18 0.00 -1.26 -0.32 105.19 113.28 1gkn n GLY 998 Ca -0.15 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 44.60 1gkn n GLY 998 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1gkn n HIS 999 N 0.00 0.00 0.00 1.61 -0.00 -1.26 -5.03 115.22 110.54 1gkn n HIS 999 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 1gkn n HIS 999 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 1gkn n HIS 999 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.34 175.21 1gkn n SER 1000N 0.00 0.00 -3.68 0.26 3.41 -1.26 -4.87 113.62 107.48 1gkn n SER 1000Ca 0.00 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.47 1gkn n SER 1000Cb 0.00 0.03 -0.08 0.00 -0.26 0.00 0.00 64.21 63.90 1gkn n SER 1000CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1gkn s SER 1001N -1.38 -0.55 -0.09 4.04 1.04 -1.26 -1.52 113.70 113.98 1gkn s SER 1001Ca 0.00 1.00 -0.13 0.00 0.48 0.00 0.00 55.95 57.30 1gkn s SER 1001Cb 0.00 1.01 0.03 0.00 0.10 0.00 0.00 66.02 67.16 1gkn s SER 1001CO 0.00 -0.24 0.33 0.00 0.98 0.00 0.00 173.24 174.30 1gkn s ALA 1002N 0.04 -0.82 -0.07 5.32 0.00 -0.87 -4.96 121.76 120.40 1gkn s ALA 1002Ca -0.02 0.74 -0.12 0.00 0.00 0.00 0.00 51.96 52.56 1gkn s ALA 1002Cb -0.04 -0.34 -0.05 0.00 0.00 0.00 0.00 23.12 22.70 1gkn s ALA 1002CO 0.02 -0.20 0.30 -2.00 0.00 0.00 0.00 175.76 173.89 1gkn s GLU 1003N -0.35 3.82 0.08 0.00 2.12 -1.26 -1.80 118.70 121.32 1gkn s GLU 1003Ca -0.05 0.19 -0.31 0.00 0.36 0.00 0.00 54.97 55.16 1gkn s GLU 1003Cb -0.03 -3.25 -0.07 0.00 0.26 0.00 0.00 34.13 31.04 1gkn s GLU 1003CO 0.02 0.64 1.31 0.00 -0.54 0.00 0.00 175.26 176.69 1gkn s ILE 1005N 1.19 0.13 0.03 0.00 -4.36 -0.80 -1.78 121.20 115.61 1gkn s ILE 1005Ca 0.62 -0.59 -0.20 0.00 -0.26 0.00 0.00 60.65 60.22 1gkn s ILE 1005Cb -0.33 -0.22 -0.06 0.00 1.25 0.00 0.00 42.46 43.10 1gkn s ILE 1005CO 0.29 -0.29 0.58 -0.22 0.24 0.00 0.00 174.94 175.54 1gkn s LEU 1006N -0.92 4.47 -0.10 0.37 2.96 -1.26 -1.71 118.68 122.49 1gkn s LEU 1006Ca -0.09 1.20 -0.08 0.00 -0.22 0.00 0.00 54.13 54.94 1gkn s LEU 1006Cb -0.06 -2.90 -0.27 0.00 0.50 0.00 0.00 46.19 43.45 1gkn s LEU 1006CO -0.00 0.18 0.45 0.77 -1.32 0.00 0.00 176.35 176.43 1gkn h SER 1007N 5.13 0.47 0.00 3.68 4.64 -1.88 -3.48 113.55 122.11 1gkn h SER 1007Ca -0.47 -0.95 0.00 0.00 -0.47 0.00 0.00 61.79 59.90 1gkn h SER 1007Cb 1.21 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 1gkn h SER 1007CO 0.67 1.84 0.00 0.61 -0.87 0.00 0.00 176.83 179.08 1gkn n GLY 1008N 1.96 0.02 0.88 -0.77 0.00 -1.26 -5.00 105.19 101.03 1gkn n GLY 1008Ca -0.30 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1gkn n GLY 1008CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1gkn n ASN 1009N -0.39 0.00 -4.75 1.61 4.13 -1.26 -4.91 115.26 109.69 1gkn n ASN 1009Ca 0.00 0.00 -0.37 0.00 1.68 0.00 0.00 54.58 55.89 1gkn n ASN 1009Cb 0.00 0.06 -0.07 0.00 -1.54 0.00 0.00 39.78 38.23 1gkn n ASN 1009CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1gkn s THR 1010N -1.44 5.23 0.17 3.41 2.01 -1.26 -5.00 115.64 118.76 1gkn s THR 1010Ca 0.00 0.71 -0.27 0.00 0.31 0.00 0.00 61.69 62.44 1gkn s THR 1010Cb 0.00 -3.69 -0.08 0.00 0.01 0.00 0.00 72.50 68.74 1gkn s THR 1010CO 0.00 0.41 0.84 0.00 -0.69 0.00 0.00 174.62 175.17 1gkn s ALA 1011N 0.23 3.39 -0.17 7.40 0.00 -1.26 -3.05 121.76 128.31 1gkn s ALA 1011Ca 0.20 0.44 -0.21 0.00 0.00 0.00 0.00 51.96 52.40 1gkn s ALA 1011Cb -0.14 -3.06 0.05 0.00 0.00 0.00 0.00 23.12 19.97 1gkn s ALA 1011CO 0.07 0.21 0.55 -3.38 0.00 0.00 0.00 175.76 173.22 1gkn s HIS 1012N -0.91 -0.58 0.49 0.00 -3.43 -0.69 -4.89 115.29 105.28 1gkn s HIS 1012Ca 0.39 1.32 -0.22 0.00 -0.80 0.00 0.00 55.06 55.74 1gkn s HIS 1012Cb -0.24 0.23 -0.06 0.00 -1.43 0.00 0.00 32.58 31.08 1gkn s HIS 1012CO 0.28 -0.36 1.24 -1.58 -2.00 0.00 0.00 174.74 172.32 1gkn s TRP 1013N -0.11 2.66 0.45 0.38 0.52 -1.26 -1.90 118.94 119.69 1gkn s TRP 1013Ca -0.03 1.48 0.22 0.00 0.02 0.00 0.00 56.10 57.78 1gkn s TRP 1013Cb -0.03 -3.53 1.20 0.00 -1.15 0.00 0.00 33.47 29.95 1gkn s TRP 1013CO 0.03 -2.01 1.85 0.77 0.02 0.00 0.00 176.95 177.61 1gkn h SER 1014N 1.84 0.30 0.00 2.95 0.02 -1.67 -3.45 113.55 113.54 1gkn h SER 1014Ca -0.50 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 1gkn h SER 1014Cb 1.27 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.79 1gkn h SER 1014CO 0.59 0.11 0.00 0.35 -1.14 0.00 0.00 176.83 176.74 1gkn n THR 1015N -4.46 0.00 -4.26 -2.27 -2.24 -1.26 -5.04 114.28 94.74 1gkn n THR 1015Ca 0.20 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.76 1gkn n THR 1015Cb 0.80 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.90 1gkn n THR 1015CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1gkn s LYS 1016N 1.79 1.04 0.28 -0.78 0.00 -1.26 -5.07 119.74 115.74 1gkn s LYS 1016Ca 0.00 -1.09 -0.30 0.00 0.00 0.00 0.00 55.97 54.58 1gkn s LYS 1016Cb 0.00 -1.22 -0.12 0.00 0.00 0.00 0.00 37.83 36.49 1gkn s LYS 1016CO 0.00 0.28 1.49 -2.30 0.00 0.00 0.00 175.35 174.83 1gkn n PRO 1017N 1.18 2.40 0.00 1.78 -0.02 -1.26 -4.64 135.00 134.45 1gkn n PRO 1017Ca -0.20 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 1gkn n PRO 1017Cb 0.54 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 1gkn n PRO 1017CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1gkn n PRO 1018N 1.88 1.05 -3.72 0.52 -0.02 -1.26 -4.87 135.00 128.58 1gkn n PRO 1018Ca 0.09 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.44 1gkn n PRO 1018Cb 0.35 0.00 -0.13 0.00 -0.02 0.00 0.00 33.50 33.70 1gkn n PRO 1018CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 1gkn s ILE 1019N 0.00 -0.08 0.13 4.25 2.07 0.56 -4.72 121.20 123.41 1gkn s ILE 1019Ca 0.00 0.16 -0.25 0.00 -1.41 0.00 0.00 60.65 59.15 1gkn s ILE 1019Cb 0.00 -0.39 -0.07 0.00 0.13 0.00 0.00 42.46 42.13 1gkn s ILE 1019CO 0.00 0.07 0.77 0.00 -1.91 0.00 0.00 174.94 173.87 1gkn s GLN 1021N -0.85 0.37 0.10 0.00 0.74 -0.68 -4.89 119.66 114.46 1gkn s GLN 1021Ca 0.36 0.58 -0.36 0.00 0.05 0.00 0.00 55.36 55.99 1gkn s GLN 1021Cb -0.22 0.09 -0.16 0.00 1.10 0.00 0.00 33.01 33.81 1gkn s GLN 1021CO 0.25 -0.10 1.34 -2.13 -0.55 0.00 0.00 175.29 174.11 1gkn n ARG 1022N 3.48 1.21 -2.44 1.67 0.63 -1.26 0.18 116.66 120.11 1gkn n ARG 1022Ca -0.18 0.43 -0.42 0.00 -0.92 0.00 0.00 57.85 56.77 1gkn n ARG 1022Cb 0.56 -2.07 -0.03 0.00 0.45 0.00 0.00 32.46 31.37 1gkn n ARG 1022CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1gkn s ILE 1023N 0.45 4.18 -2.00 5.15 1.01 -1.13 -4.75 121.20 124.10 1gkn s ILE 1023Ca 0.83 1.53 0.04 0.00 0.00 0.00 0.00 60.65 63.05 1gkn s ILE 1023Cb -0.93 -3.98 0.10 0.00 0.01 0.00 0.00 42.46 37.66 1gkn s ILE 1023CO 0.47 0.05 0.69 -2.65 0.00 0.00 0.00 174.94 173.50